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CHEBI:151315 - Heparinsodiumsalt
| Formula | C12H21NO20S3 |
| Net Charge | 0 |
| Average Mass | 595.488 |
| Monoisotopic Mass | 594.98191 |
| SMILES | O=C(O)[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](NS(=O)(=O)O)[C@@H](O)O[C@@H]2COS(=O)(=O)O)[C@H](OS(=O)(=O)O)[C@@H](O)[C@@H]1O |
| WURCS | WURCS=2.0/2,2,1/[a2122h-1a_1-5_2*NSO/3=O/3=O_6*OSO/3=O/3=O][a2121A-1a_1-5_2*OSO/3=O/3=O]/1-2/a4-b1 |
| InChI | InChI=1S/C12H21NO20S3/c14-4-3(13-34(20,21)22)11(19)30-2(1-29-35(23,24)25)7(4)31-12-9(33-36(26,27)28)6(16)5(15)8(32-12)10(17)18/h2-9,11-16,19H,1H2,(H,17,18)(H,20,21,22)(H,23,24,25)(H,26,27,28)/t2-,3-,4-,5+,6+,7-,8-,9-,11+,12-/m1/s1 |
| InChIKey | OHJKXVLJWUPWQG-PNRHKHKDSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Heparinsodiumsalt (CHEBI:151315) is a carbohydrates and carbohydrate derivatives (CHEBI:78616) |
| Synonyms | Source |
|---|---|
| 2-O-sulfo-alpha-L-ido-hexopyranosyluronic acid-(1->4)-2-deoxy-6-O-sulfo-2-sulfoamino-alpha-D-gluco-hexopyranose | SUBMITTER |
| IdoA2S(a1-4)a-GlcNS6S | SUBMITTER |